⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL17801456 | 0.74 | — | — | |
| SCHEMBL12982445 | 0.74 | — | — | |
| SCHEMBL5162693 | 0.70 | — | — | |
| SCHEMBL17801590 | 0.70 | — | — | |
| SCHEMBL28030012 | 0.69 | — | — | |
| SCHEMBL2369720 | 0.69 | — | — | |
| SCHEMBL16133342 | 0.67 | — | — | |
| SCHEMBL12475284 | 0.67 | — | — | |
| SCHEMBL23793181 | 0.67 | — | — | |
| SCHEMBL10901888 | 0.67 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016087593-A1 | NOVEL FUNGICIDAL QUINOLINYLAMIDINES | SYNGENTA PARTICIPATIONS AG (CH) | 2016-06-09 | — | — | WO | disclosed |